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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 37 records · Page 2

Examining the order-of-limits problem and lattice constant performance of the Tao–Mo functional

In their recent communication a semi-local density functional derived from the density matrix expansion of the exchange hole localised by a general coordinate transformation. We show that the order-of-limits problem present in the functional, dismissed as harmless in the original publication, causes severe errors in predicted phase transition pressures. We also show that the claim that lattice volume prediction accuracy exceeds that of existing similar functionals was based on comparison to reference data that misses anharmonic zero-point expansion and consequently overestimates accuracy. Here, by highlighting these omissions, we give a more accurate assessment of the Tao-Mo functional and show a possible direction for resolving the order-of-limits problem.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Paleomagnetism and Tectonic Interpretations of the Taos Plateau Volcanic Field, Rio Grande Rift, New Mexico

The tectonic response of the Taos Plateau volcanic field in the southern San Luis basin to the late stage extensional environment of the Rio Grande rift was investigated using paleomagnetic techniques. Sixty-two sites (533 samples) of Pliocene volcanic units were collected covering four major rock types with ages of 4.7 to 1.8 Ma. Twenty-two of these sites were from stratigraphic sections of the lower, middle and upper Servilleta Basalt collected in the Rio Grande gorge at two locations 19 km apart. Flows from the lower and middle members in the southern gorge record reversed polarities while those in Garapata Canyon are normal with an excursion event in the middle of the sequence. The uppermost flows of the upper member at both sites display normal directions. Although these sections correlate chemically, they seem to represent different magnetic time periods during the Gilbert Reversed-Polarity Chron...

Matthew P. Golombek↗

Exchange of Ions across the TiN/TaO x Interface during Electroformation of TaO x -Based Resistive Switching Devices

The valence change model describes the resistive switching in metal oxide-based devices as due to electroreduction of the oxide and subsequent electromigration of oxygen vacancies. Here, we present cross-sectional X-ray energy-dispersive spectroscopy elemental maps of Ta, O, N, and Ti in electroformed TiN/TaO 2.0 /TiN structures. O, N, and Ti were exchanged between the anode and the functional oxide in devices formed at high power (~1 mW), but the exchange was below the detection limit at low power (<0.5 mW). All structures exhibit a similar Ta-enriched and O-depleted filament formed by the elemental segregation in the functional oxide by the temperature gradient. The elemental interchange is interpreted as due to Fick’s diffusion caused by high temperatures in the gap of the filament and is not an essential part of electroformation.

36 MATERIALS SCIENCE↗

Mathematics: The Tao of Data Science

The two pieces, "Ten Research Challenge Areas in Data Science" by Jeannette M. Wing and “Challenges and Opportunities in Statistics and Data Science: Ten Research Areas” by Xuming He and Xihong Lin, provide an impressively complete list of data science challenges from luminaries in the field of data science. They have done an extraordinary job, so this response offers a complementary viewpoint from a mathematical perspective and evangelizes advanced mathematics as a key tool for meeting the challenges they have laid out. Notably, we pick up the themes of scientific understanding of machine learning and deep learning, computational considerations such as cloud computing and scalability, balancing computational and statistical considerations, and inference with limited data. We propose that mathematics is an important key to establishing rigor in the field of data science and as such has an essential role to play in its future.

97 MATHEMATICS AND COMPUTING↗

Synthesis of epitaxial TaO$_2$ thin films on Al$_2$O$_3$ by suboxide molecular-beam epitaxy and thermal laser epitaxy

Tantalum dioxide (TaO2) is a metastable tantalum compound. Here, we report the epitaxial stabilization of TaO2 on Al2O3 (1-102) (r-plane sapphire) substrates using suboxide molecular-beam epitaxy (MBE) and thermal laser epitaxy (TLE), demonstrating single-oriented, monodomain growth of anisotropically strained thin films. Microstructural investigation is performed using synchrotron X-ray diffraction and scanning transmission electron microscopy. The tetravalent oxidation state of tantalum is confirmed using X-ray absorption and photoemission spectroscopy as well as electron energy-loss spectroscopy. Optical properties are investigated via spectroscopic ellipsometry and reveal a 0.3 eV Mott gap of the tantalum 5d electrons. Density-functional theory and group theoretical arguments are used to evaluate the limited stability of the rutile phase and reveal the potential to unlock a hidden metal-insulator transition concomitant with a structural phase transition to a distorted rutile phase, akin to NbO2. Our work expands the understanding of tantalum oxides and paves the way for their integration into next-generation electronic and photonic devices.

FOS: Physical sciences↗

Open system magnetic evolution of the taos plateau volcanic field, Northern New Mexico. I - The petrology and geochemistry of the servilleta basalt

MULTIFIT, an embodiment of the conceptual structure needed in modeling multisource and multiprocess magmatic systems, is described. This program, which uses familiar materials balance methodology and the equilibrium form of the Rayleigh equations, links evolutionary arrays, which is turn collectively relate the starting and final compositions of a given magmatic system. Moreover, MULTIFIT incorporates variations within major element data arrays; the linkage between them can be tested using an extension of the least squares algorithm, which selects the best branch point according to the minimum-sum-of-squared-residuals criterion. Advantages and disadvantages of the materials balance approach used in this program are discussed, an example is provided, and equations utilized by MULTIFIT are summarized. While MULTIFIT may not be the best approach for poorly constrained models involving partial melting for complex mixing, it may ultimately prove useful for ascertaining trace element partition coefficients in magnetic systems.

Dungan, M. A.↗

TAU as Tao

This paper discusses the feasibility of building and launching a truly deep-space spacecraft mission that will penetrate near interstellar space to a depth of one thousand astronomical units (TAU) within a flight time of 50 years. Particular attention is given to the mission profile and to its communications system, power system, and propulsion system. Results of experimental studies indicate that, with advanced technology, reasonable trip times can be achieved and adequate science information can be brought to earth.

Lyman, P. T.↗

TAO Test Vector Evaluation Rev. 1

A group of encounter sets is evaluated as a standard for defining and refining both performance-based and functional-based terminal area MOPS requirements. DAIDALUS-alerting is used together with a variety of sensor configurations: (1) ADS-B level surveillance, (2) TCAS II, (3) ground-based RADAR with three different sets of error parameters.

Adami, Tony↗

Models, In situ, and Remote Sensing of Aerosols (MIRA)

There is a natural partitioning of scientific interest amongst three specialties of aerosol re-search: modeling, in situ measurements, and remote sensing. The broader aerosol community benefits when these groups interact, and this strengthens overall scientific impact on climate and air quality research and predictions. The new MIRA working group establishes a forum for identifying collaborations and improving discussions amongst specialties and across regional boundaries. One area of keen interest is uniting satellite and ground-based lidar groups with other aerosol disciplines. Elastic backscatter lidars depend upon a priori knowledge of aerosol properties to convert measured lidar profiles into aerosol extinction profiles. Acquiring additional insight on aerosol properties and transport is highly valuable to these lidar groups to improve the data quality and aid in their scientific interpretation. Another area of interest is to facilitate the incorporation of measurements into global aerosol models. Modelers need aerosol optical look-up tables that enable quick conversions of hydrated (and dry) polydisperse size distributions into aerosol optical properties (extinction, scattering, etc.), but many of the existing tables are based upon outdated measurements. Thus, MIRA is building the Tables of Aerosol Optics (TAO), which is a community collection of aerosol optical calculations. This expands on the historical efforts of Shettle and Fenn, d’Almeida, GADS, OPAC, etc., except that TAO seeks continual input from the community. Thus, as aerosol measurement and computational techniques advance, so does the TAO collective. Since TAO is a community collective, it is expected that users will optionally upload computations for aerosol type as well as computations for all of the traditional aerosol species(like amm sulfate, amm nitrate, organics, etc.). The near-term purpose of the MIRA working group is to: *Characterize regional aerosol lidar ratios to support improvements of aerosol extinction profiles and understanding of aerosol typing. *Create TAO --a community cooperative of aerosol optical tables. *Facilitate international communications between aerosol measurement and modeling groups. *Encourage the use of regional knowledge to develop and improve remote sensing techniques for current and future backscatter lidars located in space. *Enable and foster communication between the scientists who run global aerosol models and scientists who analyze space-based lidar data. We will discuss how a collaborative aerosol working group will be organized on this topic. Those who are interested in MIRA can sign up for the MIRA email listserver at https://forms.gle/qdbCnngzNJc5YJi57.

Greg Schuster↗

Models, In situ, and Remote sensing of Aerosols (MIRA): Formation of an International Working Group

There is a natural partitioning of scientific interest amongst three specialties of aerosol re- search: modeling, in situ measurements, and remote sensing. The broader aerosol community benefits when these groups interact, and this strengthens overall scientific impact on climate and air quality research and predictions. The new MIRA working group establishes a forum for identifying collaborations and improving discussions amongst specialties and across regional boundaries. One area of keen interest is uniting satellite and ground-based lidar groups with other aerosol disciplines. Elastic backscatter lidars depend upon a priori knowledge of aerosol properties to convert measured lidar profiles into aerosol extinction profiles. Acquiring additional insight on aerosol properties and transport is highly valuable to these lidar groups to improve the data quality and aid in their scientific interpretation. Another area of interest is to facilitate the incorporation of measurements into global aerosol models. Modelers need aerosol optical look-up tables that enable quick conversions of hydrated (and dry) polydisperse size distributions into aerosol optical properties (extinction, scattering, etc.), but many of the existing tables are based upon outdated measurements. Thus, MIRA is building the Tables of Aerosol Optics (TAO), which is a community collection of aerosol optical calculations. This expands on the historical efforts of Shettle and Fenn, d’Almeida, GADS, OPAC, etc., except that TAO seeks continual input from the community. Thus, as aerosol measurement and computational techniques advance, so does the TAO collective. Since TAO is a community collective, it is expected that users will optionally upload computations for aerosol type as well as computations for all of the traditional aerosol species (like amm sulfate, amm nitrate, organics, etc.). The near-term purpose of the MIRA working group is to: * Characterize regional aerosol lidar ratios to support improvements of aerosol extinction profiles and understanding of aerosol typing. * Create TAO -- a community cooperative of aerosol optical tables. * Facilitate international communications between aerosol measurement and modeling groups. * Encourage the use of regional knowledge to develop and improve remote sensing techniques for current and future backscatter lidars located in space. * Enable and foster communication between the scientists who run global aerosol models and scientists who analyze space-based lidar data. We will discuss how a collaborative aerosol working group will be organized on this topic. Send email to calipso_v5alr-join@lists.nasa.gov with the word `subscribe' in the subject line to join MIRA.

Gregory Schuster↗

Tantalum oxide and nitride spectral features from a laser-produced plasma

Here, we report measurements of time-resolved Ta, TaO and TaN emission spectroscopic signatures from a laser-produced plasma. Plasmas were generated using 1064 nm, 6 ns pulses from an Nd:YAG laser focused onto a pure Ta metal target in a gaseous environment with varying percentages of O 2 /N 2 for controlling gas-phase oxidation/plasma chemistry. Time-resolved analysis showed that Ta oxide emission is prominent at later times in plasma evolution, whereas strong atomic emission is present at early times in air. Emission spectral features as a function of O 2 partial pressure showed that TaO emission intensity increases, while the peak intensity of TaO appears earlier with increasing O 2 availability. We also report emission spectra of TaN, and show that plasma chemistry favors TaO formation instead of TaN when O 2 is present in the environment.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The Goddard Cumulus Ensemble Model (GCE): Improvements and Applications for Studying Precipitation Processes

Convection is the primary transport process in the Earth's atmosphere. About two-thirds of the Earth's rainfall and severe floods derive from convection. In addition, two-thirds of the global rain falls in the tropics, while the associated latent heat release accounts for three-fourths of the total heat energy for the Earth's atmosphere. Cloud-resolving models (CRMs) have been used to improve our understanding of cloud and precipitation processes and phenomena from micro-scale to cloud-scale and mesoscale as well as their interactions with radiation and surface processes. CRMs use sophisticated and realistic representations of cloud microphysical processes and can reasonably well resolve the time evolution, structure, and life cycles of clouds and cloud systems. CRMs also allow for explicit interaction between clouds, outgoing longwave (cooling) and incoming solar (heating) radiation, and ocean and land surface processes. Observations are required to initialize CRMs and to validate their results. The Goddard Cumulus Ensemble model (GCE) has been developed and improved at NASA/Goddard Space Flight Center over the past three decades. It is amulti-dimensional non-hydrostatic CRM that can simulate clouds and cloud systems in different environments. Early improvements and testing were presented in Tao and Simpson (1993) and Tao et al. (2003a). A review on the application of the GCE to the understanding of precipitation processes can be found in Simpson and Tao (1993) and Tao (2003). In this paper, recent model improvements (microphysics, radiation and land surface processes) are described along with their impact and performance on cloud and precipitation events in different geographic locations via comparisons with observations. In addition, recent advanced applications of the GCE are presented that include understanding the physical processes responsible for diurnal variation, examining the impact of aerosols (cloud condensation nuclei or CCN and ice nuclei or IN) on precipitation processes, utilizing a satellite simulator to improve the microphysics, providing better simulations for satellite-derived latent heating retrieval, and coupling with a general circulation model to improve the representation of precipitation processes.

GCE↗